3-Phenyl-2-sulfanylpropanoic acid
TL;DR: 3-Phenyl-2-sulfanylpropanoic acid (CAS 90536-15-5) is a chemical compound with molecular formula C9H10O2S and molecular weight 182.04015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-2-sulfanylpropanoic acid
Also Known As: 3-phenyl-2-sulfanylpropanoic acid, pd 145305, Benzylthioglykolsaure, Benzylmercaptoacetic acid, 3-phenyl-2-sulfanyl-propanoic Acid
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H10O2S |
| Molecular Weight | 182.04015 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.04015 Da |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
| SMILES | C1=CC=C(C=C1)CC(C(=O)O)S |
| InChIKey | HGIOOMCLOWLFTJ-UHFFFAOYSA-N |
Product Description
Applications: 3-Phenyl-2-sulfanylpropanoic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-Phenyl-2-sulfanylpropanoic acid (CAS 90536-15-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
3-Phenyl-2-sulfanylpropanoic acid (CAS 90536-15-5) is a heterocyclic building block with the molecular formula C9H10O2S and a molecular weight of 182.04 g/mol. It is also known as 3-phenyl-2-sulfanylpropanoic acid and pd 145305.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3-Phenyl-2-sulfanylpropanoic acid
Property Insights of 3-Phenyl-2-sulfanylpropanoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-2-sulfanylpropanoic acid. With a topological polar surface area (TPSA) of 38.3 Ų, 3-Phenyl-2-sulfanylpropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-2-sulfanylpropanoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Phenyl-2-sulfanylpropanoic acid?
The CAS number of 3-Phenyl-2-sulfanylpropanoic acid is 90536-15-5.
What is the molecular formula of 3-Phenyl-2-sulfanylpropanoic acid?
The molecular formula of 3-Phenyl-2-sulfanylpropanoic acid is C9H10O2S.
What is the molecular weight of 3-Phenyl-2-sulfanylpropanoic acid?
The molecular weight of 3-Phenyl-2-sulfanylpropanoic acid is 182.04015 g/mol.
What are the applications of 3-Phenyl-2-sulfanylpropanoic acid?
3-Phenyl-2-sulfanylpropanoic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 3-Phenyl-2-sulfanylpropanoic acid?
You can request a quote for 3-Phenyl-2-sulfanylpropanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Phenyl-2-sulfanylpropanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-Phenyl-2-sulfanylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.